diff --git a/content/multipledataset.html b/content/multipledataset.html
index 59cd70be..9f8e852e 100644
--- a/content/multipledataset.html
+++ b/content/multipledataset.html
@@ -106,10 +106,16 @@ draft: false
const subdoi = sub.filter(d => d.DOI.string === doi)
for (mol of uniq(subdoi.map(d => d.molecule))) {
const submol = subdoi.filter(d => d.molecule === mol)
- const TBE = submol.find((d) => d.method.isTBE)
- if (TBE !== undefined) {
- for (dat of submol.filter((d) => d !== TBE)) {
- dat.CopyExcitationsTypeFrom(TBE)
+ const source = submol.find((d) => {
+ if (d.DOI.string==="10.1021/acs.jctc.8b01205") {
+ return d.method.name==="CASPT2" && d.method.basis==="aug-cc-pVDZ"
+ } else {
+ return d.method.isTBE
+ }
+ })
+ if (source !== undefined) {
+ for (dat of submol.filter((d) => d !== source)) {
+ dat.CopyExcitationsTypeFrom(source)
}
}
}